ALDAX

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Revision as of 15:35, 15 February 2023 by Ftran (talk | contribs)

ALDAX = [real]
Default: ALDAX = 1.0-AEXX if LHFCALC=.TRUE. or 1.0 if LHFCALC=.FALSE. 

Description: ALDAX is a parameter that multiplies the LDA exchange functional or the LDA part of a GGA exchange functional.


ALDAX can be used as the fraction of LDA exchange in a Hartree-Fock/LDA or Hartree-Fock/GGA hybrid functional.

Note that for versions of VASP prior to 6.4.0, ALDAX was constrained to be equal to 1.0-AEXX. This constraint has been lifted since VASP.6.4.0.

Related tags and articles

AEXX, ALDAC, AGGAX, AGGAC, AMGGAX, AMGGAC, LHFCALC, List of hybrid functionals

Examples that use this tag